Known targets — ChEMBL curated mechanism
DHFRGARTPTGFRPTGIRPTGS1PTGS2TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8envmurAthyA
The experimentally established mechanism targets of Tromethamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7738115 | 0.82 | TDP1 (0.42) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| Tromethamine SCHEMBL7788472 | 0.77 | MEN1 (0.37) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| Tromethamine SCHEMBL473619 | 0.69 | — | — | |
| SCHEMBL11613505 | 0.66 | TSHR (0.35) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL8129030 | 0.65 | TDP1 (0.39) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| Tromethamine SCHEMBL10764184 | 0.65 | KDM4E (0.40) | MEN1KMT2ATDP1LMNAALOX15 | |
| SCHEMBL6285005 | 0.62 | MEN1 (0.55) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL11617693 | 0.62 | TSHR (0.38) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL94118 | 0.60 | KLK1 (0.45) | MEN1KMT2ACYP3A4TSHRTDP1 | |
| SCHEMBL11451272 | 0.60 | TSHR (0.39) | MEN1KMT2ACYP3A4TSHRTDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5627165-A | ANTIVIRAL AND ANTILEUKEMIA AGENTS | DRUG INNOVATION & DESIGN, INC. (US) | 1997-05-06 | — | — | US | disclosed |
| EP-0533833-A1 | PHOSPHOROUS PRODRUGS. | GLAZIER ARNOLD (US) | 1993-03-31 | — | — | EP | disclosed |